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1,6-DIHYDROXY-5-ETHYLSULFANYL-4Z-EN-HEX-2-YNYL
SpectraBase Compound ID AtJlvpNAeHI
InChI InChI=1S/C8H12O2S/c1-2-11-8(7-10)5-3-4-6-9/h5,9-10H,2,6-7H2,1H3/b8-5-
InChIKey YGEVLHGINFWEQS-YVMONPNESA-N
Mol Weight 172.24 g/mol
Molecular Formula C8H12O2S
Exact Mass 172.055801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Qo95IQ5MeY
Name 1,6-DIHYDROXY-5-ETHYLSULFANYL-4Z-EN-HEX-2-YNYL
Compound Number III
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12O2S
InChI InChI=1S/C8H12O2S/c1-2-11-8(7-10)5-3-4-6-9/h5,9-10H,2,6-7H2,1H3/b8-5-
InChIKey YGEVLHGINFWEQS-YVMONPNESA-N
Literature Reference Author A.V.AFONIN,S.Y.KUZNETSOVA,I.A.USHAKOV,V.K.VORONOV,E.I.BASINA ,A.N.VOLKOV,K.A.VOLK
Literature Reference Citation RUSS.J.ORG.CHEM.,38,1437(2002)
Literature Reference DOI 10.1023/A:1022535901177
Molecular Weight 172.242 g/mol
Solvent CDCl3
Source File Reference UWVN5770